Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6855145 | 0.77 | DAO (0.32) | — | |
| SCHEMBL1062547 | 0.72 | KDM4E (0.33) | KMT2A | |
| SCHEMBL6849820 | 0.72 | CHRNB2 (0.41) | CYP3A4TSHRMEN1PTGS1DRD3 | |
| SCHEMBL6854948 | 0.69 | MAPT (0.34) | CYP3A4MEN1PTGS1DRD3KMT2A | |
| SCHEMBL6858068 | 0.65 | CHRNB2 (0.41) | CYP3A4TSHRMEN1PTGS1DRD3 | |
| SCHEMBL6856079 | 0.64 | CHRNA4 (0.47) | MEN1KMT2A | |
| SCHEMBL27272020 | 0.64 | KMT2A (0.38) | CYP3A4TSHRMEN1KMT2A | |
| SCHEMBL28277550 | 0.64 | PPARA (0.47) | CYP3A4TSHRMEN1PTGS1DRD3 | |
| SCHEMBL11386832 | 0.61 | HSP90AB1 (0.41) | TSHRMEN1KMT2A | |
| SCHEMBL28385050 | 0.61 | HSP90AB1 (0.46) | CYP3A4TSHRMEN1KMT2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6831177-B1 | Preparation of their intermediates, 2-acyl-5-benzylfuran derivatives and 1,2,4-triazole-3- carboxylic acid ester derivatives | SHIONOGI & CO., LTD. (JP) | 2004-12-14 | — | — | US | disclosed |
| EP-1186599-A1 | NOVEL PROCESSES FOR THE PREPARATION OF SUBSTITUTED PROPENONE DERIVATIVES | SHIONOGI & CO., LTD. (JP) | 2002-03-13 | — | — | EP | disclosed |